M. Yung, J. Whitfield, S. Boixo, D. G. Tempel, A. Aspuru‐Guzik
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Introduction to Quantum Algorithms for Physics and Chemistry
An enormous number of model chemistries are used in computational chemistry to solve or approximately solve the Schrodinger equation; each with their own drawbacks. One key limitation is that the hardware used in computational chemistry is based on classical physics, and is often not well suited for simulating models in quantum physics. In this review, we focus on applications of quantum computation to chemical physics problems. We describe the algorithms that have been proposed for the electronic- structure problem, the simulation of chemical dynamics, thermal state preparation, density functional theory and adiabatic quantum simulation.
期刊介绍:
A landmark in publishing and science, Advances in Chemical Physics is an international forum for the review and critical evaluation of the science that has propelled every area of the discipline. Each volume contains discussions of aspects of the state of diverse subjects in chemical physics and related fields, with chapters written by top researchers in the field from around the world.
The series now comprises more than 150 volumes covering the period from the mid 1960’s to the present. Collectively, they represent the history of modern chemical physics. Discussions of all areas of chemical physics, with extensions to biophysics and soft matter physics can be found in these volumes.